3-methanesulfonyl-4H-1,2,4-triazole
5-methylsulfonyl-1H-1,2,4-triazole
Also Known As: 3-(methylsulfonyl)-1H-1,2,4-triazole|5-methylsulfonyl-1H-1,2,4-triazole|3-methanesulfonyl-4H-1,2,4-triazole|3-methylsulfonyl-1,2,4-triazole|3-methylsulphonyl-1,2,4-triazole|3-Methanesulfonyl-1H-[1,2,4]triazole|3-METHANESULFONYL-1H-1,2,4-TRIAZOLE|5-(Methanesulfonyl)-1H-1,2,4-triazole|BAS 04456393|Y-6640|960-613-2
CAS: 3589-05-7
| Molecular Formula | C3H5N3O2S |
|---|---|
| Molecular Weight | 147.01025 g/mol |
| LogP | -0.7918 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.01025 |
| Monoisotopic Mass | 147.01025 |
| Heavy Atoms | 9 |
| Complexity | 274.01633 |
Chemical Identifiers
| CAS Number | 3589-05-7 |
|---|---|
| SMILES | CS(=O)(=O)C1=NC=NN1 |
Product Overview
3-methanesulfonyl-4H-1,2,4-triazole (CAS 3589-05-7), with molecular formula C3H5N3O2S and molecular weight 147.01025 g/mol. IUPAC: 5-methylsulfonyl-1H-1,2,4-triazole.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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